| BioID | bio2576 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL52003 |
|---|
| Molecular Formula | C15H23NO4S |
|---|
| Molecular Weight | 313.42 |
|---|
| Molecular Weight (Monoisotopic) | 313.1348 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | 9-Benzenesulfonylamino-Nonanoic Acid |
|---|
| Smiles | O=C(O)CCCCCCCCNS(=O)(=O)c1ccccc1 |
|---|
| Inchi | InChI=1S/C15H23NO4S/c17-15(18)12-8-3-1-2-4-9-13-16-21(19,20)14-10-6-5-7-11-14/h5-7,10-11,16H,1-4,8-9,12-13H2,(H,17,18) |
|---|
| Inchi Key | CHADKCBWJIDVLS-UHFFFAOYSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 4.0 |
|---|
| Bioactivities | 5.0 |
|---|
| Np Likeness Score | -0.76 |
|---|
| Records Key | ['4b', '6'] |
|---|
| Records Name | ['9-Benzenesulfonylamino-nonanoic acid', '9-Benzenesulfonylamino-nonanoic acid'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
